Computational Materials & Catalysis: Research Highlights and Future Directions Dr. Sabir Ali Siddique Lecturer, Institute of Chemistry, Islamia University Bahawalpur Email: [email protected]
Introduction - Background & Expertise - Research Interests - Connection to Host Group’s Work
Research Highlights - Key research contributions - Relevant studies to host's research - Computational chemistry applications
Technical Skills & Methodologies - Density Functional Theory (DFT) - Molecular Dynamics (MD) - Gaussian, VASP, ORCA, Python-based simulations - Machine learning applications in materials science
Future Research Directions - Proposed collaborations - Integration of my expertise into your projects - Novel methodologies & expected outcomes
Conclusion & Discussion - Summary of key points - Enthusiasm for collaboration - Open for questions and discussions